CID 3038843

Thiazolidine, 3-(3-(butylthio)propyl)-, hydrochloride

Structural Information

Molecular Formula
C10H21NS2
SMILES
CCCCSCCCN1CCSC1
InChI
InChI=1S/C10H21NS2/c1-2-3-7-12-8-4-5-11-6-9-13-10-11/h2-10H2,1H3
InChIKey
SKBLXRQRJMRFNC-UHFFFAOYSA-N
Compound name
3-(3-butylsulfanylpropyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.11154 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.11882 148.8
[M+Na]+ 242.10076 154.7
[M-H]- 218.10426 150.0
[M+NH4]+ 237.14536 168.7
[M+K]+ 258.07470 151.4
[M+H-H2O]+ 202.10880 142.6
[M+HCOO]- 264.10974 158.9
[M+CH3COO]- 278.12539 186.7
[M+Na-2H]- 240.08621 146.3
[M]+ 219.11099 150.8
[M]- 219.11209 150.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.